(3S)-N-[(E,3S,4S)-4-methyl-1-phenyl-hex-1-en-3-yl]-2-phenacyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3S)-N-[(E,3S,4S)-4-methyl-1-phenyl-hex-1-en-3-yl]-2-phenacyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3S)-N-[(1S,2S)-2-methyl-1-[(E)-styryl]butyl]-2-phenacyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3S)-N-[(E,3S,4S)-4-methyl-1-phenylhex-1-en-3-yl]-2-phenacyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3S)-N-[(E,3S,4S)-4-methyl-1-phenylhex-1-en-3-yl]-2-phenacyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3S)-N-[(E,1S)-1-[(1S)-1-methylpropyl]-3-phenyl-allyl]-2-phenacyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C31H34N2O2 MolecularWeight: 466.61386

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C=CC1=CC=CC=C1)NC(=O)C2CC3=CC=CC=C3CN2CC(=O)C4=CC=CC=C4

Isomeric SMILES

CC[C@H](C)[C@@H](/C=C/C1=CC=CC=C1)NC(=O)[C@@H]2CC3=CC=CC=C3CN2CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C31H34N2O2/c1-3-23(2)28(19-18-24-12-6-4-7-13-24)32-31(35)29-20-26-16-10-11-17-27(26)21-33(29)22-30(34)25-14-8-5-9-15-25/h4-19,23,28-29H,3,20-22H2,1-2H3,(H,32,35)/b19-18+/t23-,28+,29-/m0/s1