8-chloranyl-3-methyl-2-(2-methylpropoxy)-1-oxidanylidene-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide

Systemtic Name: 8-chloranyl-3-methyl-2-(2-methylpropoxy)-1-oxidanylidene-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Openeye Name: 8-chloro-2-isobutoxy-3-methyl-1-oxo-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide CAS Name: 8-chloro-3-methyl-2-(2-methylpropoxy)-1-oxo-N-[(1S)-1-phenylpropyl]-4-isoquinolinecarboxamide IUPAC Name: 8-chloro-3-methyl-2-(2-methylpropoxy)-1-oxo-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Traditional Name: 8-chloro-2-isobutoxy-1-keto-3-methyl-N-[(1S)-1-phenylpropyl]isoquinoline-4-carboxamide Formula: C24H27ClN2O3 MolecularWeight: 426.93578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)C2=C(N(C(=O)C3=C2C=CC=C3Cl)OCC(C)C)C

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)NC(=O)C2=C(N(C(=O)C3=C2C=CC=C3Cl)OCC(C)C)C

InChI

InChI=1S/C24H27ClN2O3/c1-5-20(17-10-7-6-8-11-17)26-23(28)21-16(4)27(30-14-15(2)3)24(29)22-18(21)12-9-13-19(22)25/h6-13,15,20H,5,14H2,1-4H3,(H,26,28)/t20-/m0/s1