(3S)-2-[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-[2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[2-(dibenzylamino)-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[2-[bis(phenylmethyl)amino]-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[2-(dibenzylamino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[2-(dibenzylamino)-2-keto-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H27N3O2 MolecularWeight: 413.51148

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)CC(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1[C@H](N(CC2=CC=CC=C21)CC(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C26H27N3O2/c27-26(31)24-15-22-13-7-8-14-23(22)18-28(24)19-25(30)29(16-20-9-3-1-4-10-20)17-21-11-5-2-6-12-21/h1-14,24H,15-19H2,(H2,27,31)/t24-/m0/s1