3,6-dimethyl-1-oxidanylidene-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide

Systemtic Name: 3,6-dimethyl-1-oxidanylidene-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Openeye Name: 3,6-dimethyl-1-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide CAS Name: 3,6-dimethyl-1-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]-4-isoquinolinecarboxamide IUPAC Name: 3,6-dimethyl-1-oxo-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Traditional Name: 1-keto-3,6-dimethyl-2-phenyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C(N(C(=O)C3=C2C=C(C=C3)C)C4=CC=CC=C4)C

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C(N(C(=O)C3=C2C=C(C=C3)C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H26N2O2/c1-4-24(20-11-7-5-8-12-20)28-26(30)25-19(3)29(21-13-9-6-10-14-21)27(31)22-16-15-18(2)17-23(22)25/h5-17,24H,4H2,1-3H3,(H,28,30)/t24-/m0/s1