(3R)-2-[(3S)-1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-[(3S)-1-(2-ethylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[(3S)-1-(2-ethylphenyl)-5-oxo-pyrrolidine-3-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-[[(3S)-1-(2-ethylphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[(3S)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[(3S)-1-(2-ethylphenyl)-5-keto-pyrrolidine-3-carbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CC4=CC=CC=C4CC3C(=O)N

Isomeric SMILES

CCC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)N3CC4=CC=CC=C4C[C@@H]3C(=O)N

InChI

InChI=1S/C23H25N3O3/c1-2-15-7-5-6-10-19(15)25-14-18(12-21(25)27)23(29)26-13-17-9-4-3-8-16(17)11-20(26)22(24)28/h3-10,18,20H,2,11-14H2,1H3,(H2,24,28)/t18-,20+/m0/s1