4-[3-[(2S)-5-oxidanylidene-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoyl]-1,4-diazepane-1-carbaldehyde

Systemtic Name: 4-[3-[(2S)-5-oxidanylidene-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoyl]-1,4-diazepane-1-carbaldehyde Openeye Name: 4-[3-[(2S)-5-oxo-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoyl]-1,4-diazepane-1-carbaldehyde CAS Name: 4-[1-oxo-3-[(2S)-5-oxo-2-[(4-phenylphenyl)methyl]-2-pyrrolidinyl]propyl]-1,4-diazepane-1-carboxaldehyde IUPAC Name: 4-[3-[(2S)-5-oxo-2-[(4-phenylphenyl)methyl]pyrrolidin-2-yl]propanoyl]-1,4-diazepane-1-carbaldehyde Traditional Name: 4-[3-[(2S)-5-keto-2-(4-phenylbenzyl)pyrrolidin-2-yl]propanoyl]-1,4-diazepane-1-carbaldehyde Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CCC2(CCC(=O)N2)CC3=CC=C(C=C3)C4=CC=CC=C4)C=O

Isomeric SMILES

C1CN(CCN(C1)C(=O)CC[C@@]2(CCC(=O)N2)CC3=CC=C(C=C3)C4=CC=CC=C4)C=O

InChI

InChI=1S/C26H31N3O3/c30-20-28-15-4-16-29(18-17-28)25(32)12-14-26(13-11-24(31)27-26)19-21-7-9-23(10-8-21)22-5-2-1-3-6-22/h1-3,5-10,20H,4,11-19H2,(H,27,31)/t26-/m0/s1