(3S)-2-[3,4-dimethoxy-5-[(E)-prop-1-enyl]phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-2-[3,4-dimethoxy-5-[(E)-prop-1-enyl]phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-2-[3,4-dimethoxy-5-[(E)-prop-1-enyl]benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-2-[[3,4-dimethoxy-5-[(E)-prop-1-enyl]phenyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-2-[3,4-dimethoxy-5-[(E)-prop-1-enyl]benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-2-[3,4-dimethoxy-5-[(E)-prop-1-enyl]benzoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C(C(=CC(=C1)C(=O)N2CC3=CC=CC=C3CC2C(=O)N)OC)OC

Isomeric SMILES

C/C=C/C1=C(C(=CC(=C1)C(=O)N2CC3=CC=CC=C3C[C@H]2C(=O)N)OC)OC

InChI

InChI=1S/C22H24N2O4/c1-4-7-15-10-17(12-19(27-2)20(15)28-3)22(26)24-13-16-9-6-5-8-14(16)11-18(24)21(23)25/h4-10,12,18H,11,13H2,1-3H3,(H2,23,25)/b7-4+/t18-/m0/s1