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

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-1-(9-methylcarbazol-3-yl)carbonyl-1,4-diazepan-5-one Openeye Name: 4-[(3-methoxyphenyl)methyl]-1-(9-methylcarbazole-3-carbonyl)-1,4-diazepan-5-one CAS Name: 4-[(3-methoxyphenyl)methyl]-1-[(9-methyl-3-carbazolyl)-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 4-[(3-methoxyphenyl)methyl]-1-(9-methylcarbazole-3-carbonyl)-1,4-diazepan-5-one Traditional Name: 4-m-anisyl-1-(9-methylcarbazole-3-carbonyl)-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(=CC=C4)OC)C5=CC=CC=C51

Isomeric SMILES

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

InChI

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