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

Systemtic Name: (3S)-2-[2-[(4-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[2-(4-ethoxyanilino)-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[2-(4-ethoxyanilino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[2-(4-ethoxyanilino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[2-keto-2-(p-phenetidino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2CC3=CC=CC=C3CC2C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2CC3=CC=CC=C3C[C@H]2C(=O)N

InChI

InChI=1S/C20H23N3O3/c1-2-26-17-9-7-16(8-10-17)22-19(24)13-23-12-15-6-4-3-5-14(15)11-18(23)20(21)25/h3-10,18H,2,11-13H2,1H3,(H2,21,25)(H,22,24)/t18-/m0/s1