(3R)-2-[2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-[2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[2-(N-allylanilino)-2-oxo-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-[2-oxo-2-(N-prop-2-enylanilino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[2-oxo-2-(N-prop-2-enylanilino)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[2-(N-allylanilino)-2-keto-ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O2/c1-2-12-24(18-10-4-3-5-11-18)20(25)15-23-14-17-9-7-6-8-16(17)13-19(23)21(22)26/h2-11,19H,1,12-15H2,(H2,22,26)/t19-/m1/s1