(E)-3-[4-[2-[4-cyclopropyl-5-[cyclopropyl(methyl)amino]-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[2-[4-cyclopropyl-5-[cyclopropyl(methyl)amino]-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[2-[8-cyclopropyl-1-[cyclopropyl(methyl)amino]-4,4-dimethyl-tetralin-6-yl]ethynyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[2-[4-cyclopropyl-5-[cyclopropyl(methyl)amino]-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[2-[4-cyclopropyl-5-[cyclopropyl(methyl)amino]-8,8-dimethyl-6,7-dihydro-5H-naphthalen-2-yl]ethynyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[2-[8-cyclopropyl-1-[cyclopropyl(methyl)amino]-4,4-dimethyl-tetralin-6-yl]ethynyl]phenyl]acrylic acid Formula: C30H33NO2 MolecularWeight: 439.58852

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C(C=C(C=C21)C#CC3=CC=C(C=C3)C=CC(=O)O)C4CC4)N(C)C5CC5)C

Isomeric SMILES

CC1(CCC(C2=C(C=C(C=C21)C#CC3=CC=C(C=C3)/C=C/C(=O)O)C4CC4)N(C)C5CC5)C

InChI

InChI=1S/C30H33NO2/c1-30(2)17-16-27(31(3)24-13-14-24)29-25(23-11-12-23)18-22(19-26(29)30)9-8-20-4-6-21(7-5-20)10-15-28(32)33/h4-7,10,15,18-19,23-24,27H,11-14,16-17H2,1-3H3,(H,32,33)/b15-10+