6-(3-methoxy-4-oxidanyl-phenyl)-5-pentanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-(3-methoxy-4-oxidanyl-phenyl)-5-pentanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-(4-hydroxy-3-methoxy-phenyl)-5-pentanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-(4-hydroxy-3-methoxyphenyl)-5-(1-oxopentyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-(4-hydroxy-3-methoxyphenyl)-5-pentanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-(4-hydroxy-3-methoxy-phenyl)-5-valeryl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC(=C(C=C4)O)OC

Isomeric SMILES

CCCCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC(=C(C=C4)O)OC

InChI

InChI=1S/C25H28N2O4/c1-3-4-12-23(30)27-19-10-6-5-8-17(19)26-18-9-7-11-21(29)24(18)25(27)16-13-14-20(28)22(15-16)31-2/h5-6,8,10,13-15,25-26,28H,3-4,7,9,11-12H2,1-2H3