(E)-N-hexyl-3-[4-[(E)-4-[13-methyl-3,17-bis(oxidanyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl]but-1-enyl]phenyl]prop-2-enamide

Systemtic Name: (E)-N-hexyl-3-[4-[(E)-4-[13-methyl-3,17-bis(oxidanyl)-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl]but-1-enyl]phenyl]prop-2-enamide Openeye Name: (E)-3-[4-[(E)-4-(3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl)but-1-enyl]phenyl]-N-hexyl-prop-2-enamide CAS Name: (E)-3-[4-[(E)-4-(3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl)but-1-enyl]phenyl]-N-hexyl-2-propenamide IUPAC Name: (E)-3-[4-[(E)-4-(3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl)but-1-enyl]phenyl]-N-hexylprop-2-enamide Traditional Name: (E)-3-[4-[(E)-4-(3,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-7-yl)but-1-enyl]phenyl]-N-hexyl-acrylamide Formula: C37H49NO3 MolecularWeight: 555.78986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C=CC1=CC=C(C=C1)C=CCCC2CC3=C(C=CC(=C3)O)C4C2C5CCC(C5(CC4)C)O

Isomeric SMILES

CCCCCCNC(=O)/C=C/C1=CC=C(C=C1)/C=C/CCC2CC3=C(C=CC(=C3)O)C4C2C5CCC(C5(CC4)C)O

InChI

InChI=1S/C37H49NO3/c1-3-4-5-8-23-38-35(41)20-15-27-13-11-26(12-14-27)9-6-7-10-28-24-29-25-30(39)16-17-31(29)32-21-22-37(2)33(36(28)32)18-19-34(37)40/h6,9,11-17,20,25,28,32-34,36,39-40H,3-5,7-8,10,18-19,21-24H2,1-2H3,(H,38,41)/b9-6+,20-15+