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

Systemtic Name: (3S)-2-[2-[ethyl-(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[2-(N-ethyl-2-methyl-anilino)-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[2-(N-ethyl-2-methyl-anilino)-2-keto-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1C)C(=O)CN2CC3=CC=CC=C3CC2C(=O)N

Isomeric SMILES

CCN(C1=CC=CC=C1C)C(=O)CN2CC3=CC=CC=C3C[C@H]2C(=O)N

InChI

InChI=1S/C21H25N3O2/c1-3-24(18-11-7-4-8-15(18)2)20(25)14-23-13-17-10-6-5-9-16(17)12-19(23)21(22)26/h4-11,19H,3,12-14H2,1-2H3,(H2,22,26)/t19-/m0/s1