1-(3-methylphenyl)carbonyl-4-[(2S)-1-[(3-methylphenyl)methoxy]-3-phenyl-propan-2-yl]-1,4-diazepan-5-one

Systemtic Name: 1-(3-methylphenyl)carbonyl-4-[(2S)-1-[(3-methylphenyl)methoxy]-3-phenyl-propan-2-yl]-1,4-diazepan-5-one Openeye Name: 4-[(1S)-1-benzyl-2-(m-tolylmethoxy)ethyl]-1-(3-methylbenzoyl)-1,4-diazepan-5-one CAS Name: 4-[(2S)-1-[(3-methylphenyl)methoxy]-3-phenylpropan-2-yl]-1-[(3-methylphenyl)-oxomethyl]-1,4-diazepan-5-one IUPAC Name: 1-(3-methylbenzoyl)-4-[(2S)-1-[(3-methylphenyl)methoxy]-3-phenylpropan-2-yl]-1,4-diazepan-5-one Traditional Name: 4-[(1S)-1-benzyl-2-(3-methylbenzyl)oxy-ethyl]-1-m-toluoyl-1,4-diazepan-5-one Formula: C30H34N2O3 MolecularWeight: 470.60256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COCC(CC2=CC=CC=C2)N3CCN(CCC3=O)C(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)COC[C@H](CC2=CC=CC=C2)N3CCN(CCC3=O)C(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C30H34N2O3/c1-23-8-6-12-26(18-23)21-35-22-28(20-25-10-4-3-5-11-25)32-17-16-31(15-14-29(32)33)30(34)27-13-7-9-24(2)19-27/h3-13,18-19,28H,14-17,20-22H2,1-2H3/t28-/m0/s1