1-[(3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-4-(2-phenoxyethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[(3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]-4-(2-phenoxyethyl)-1,4-diazepan-5-one Openeye Name: 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-(2-phenoxyethyl)-1,4-diazepan-5-one CAS Name: 1-[(3,5-dimethyl-1H-pyrrol-2-yl)-oxomethyl]-4-(2-phenoxyethyl)-1,4-diazepan-5-one IUPAC Name: 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-(2-phenoxyethyl)-1,4-diazepan-5-one Traditional Name: 1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-(2-phenoxyethyl)-1,4-diazepan-5-one Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C(=O)N2CCC(=O)N(CC2)CCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(N1)C(=O)N2CCC(=O)N(CC2)CCOC3=CC=CC=C3)C

InChI

InChI=1S/C20H25N3O3/c1-15-14-16(2)21-19(15)20(25)23-9-8-18(24)22(10-11-23)12-13-26-17-6-4-3-5-7-17/h3-7,14,21H,8-13H2,1-2H3