4-[(4-methoxyphenyl)methyl]-1-(9-methylcarbazol-3-yl)carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-1-(9-methylcarbazol-3-yl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-[(4-methoxyphenyl)methyl]-1-(9-methylcarbazole-3-carbonyl)-1,4-diazepan-5-one CAS Name: 4-[(4-methoxyphenyl)methyl]-1-[(9-methyl-3-carbazolyl)-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 4-[(4-methoxyphenyl)methyl]-1-(9-methylcarbazole-3-carbonyl)-1,4-diazepan-5-one Traditional Name: 1-(9-methylcarbazole-3-carbonyl)-4-p-anisyl-1,4-diazepan-5-one Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=O)N3CCC(=O)N(CC3)CC4=CC=C(C=C4)OC)C5=CC=CC=C51

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=O)N3CCC(=O)N(CC3)CC4=CC=C(C=C4)OC)C5=CC=CC=C51

InChI

InChI=1S/C27H27N3O3/c1-28-24-6-4-3-5-22(24)23-17-20(9-12-25(23)28)27(32)29-14-13-26(31)30(16-15-29)18-19-7-10-21(33-2)11-8-19/h3-12,17H,13-16,18H2,1-2H3