3-(ethylaminomethyl)-N-[(1S)-2-oxidanylidene-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide

Systemtic Name: 3-(ethylaminomethyl)-N-[(1S)-2-oxidanylidene-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide Openeye Name: 3-(ethylaminomethyl)-N-[(1S)-2-oxo-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide CAS Name: 3-(ethylaminomethyl)-N-[(1S)-2-oxo-1-phenylpropyl]-2-phenyl-1H-isoquinoline-4-carboxamide IUPAC Name: 3-(ethylaminomethyl)-N-[(1S)-2-oxo-1-phenylpropyl]-2-phenyl-1H-isoquinoline-4-carboxamide Traditional Name: 3-(ethylaminomethyl)-N-[(1S)-2-keto-1-phenyl-propyl]-2-phenyl-1H-isoquinoline-4-carboxamide Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=C(C2=CC=CC=C2CN1C3=CC=CC=C3)C(=O)NC(C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CCNCC1=C(C2=CC=CC=C2CN1C3=CC=CC=C3)C(=O)N[C@@H](C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C28H29N3O2/c1-3-29-18-25-26(28(33)30-27(20(2)32)21-12-6-4-7-13-21)24-17-11-10-14-22(24)19-31(25)23-15-8-5-9-16-23/h4-17,27,29H,3,18-19H2,1-2H3,(H,30,33)/t27-/m1/s1