N-[5-chloranyl-3-(hydroxymethyl)-6-methyl-1,2,4,9-tetrahydrocarbazol-3-yl]-6-methoxy-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[5-chloranyl-3-(hydroxymethyl)-6-methyl-1,2,4,9-tetrahydrocarbazol-3-yl]-6-methoxy-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[5-chloro-3-(hydroxymethyl)-6-methyl-1,2,4,9-tetrahydrocarbazol-3-yl]-6-methoxy-2-phenyl-quinoline-4-carboxamide CAS Name: N-[5-chloro-3-(hydroxymethyl)-6-methyl-1,2,4,9-tetrahydrocarbazol-3-yl]-6-methoxy-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[5-chloro-3-(hydroxymethyl)-6-methyl-1,2,4,9-tetrahydrocarbazol-3-yl]-6-methoxy-2-phenylquinoline-4-carboxamide Traditional Name: N-(5-chloro-6-methyl-3-methylol-1,2,4,9-tetrahydrocarbazol-3-yl)-6-methoxy-2-phenyl-cinchoninamide Formula: C31H28ClN3O3 MolecularWeight: 526.02532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)NC3=C2CC(CC3)(CO)NC(=O)C4=CC(=NC5=C4C=C(C=C5)OC)C6=CC=CC=C6)Cl

Isomeric SMILES

CC1=C(C2=C(C=C1)NC3=C2CC(CC3)(CO)NC(=O)C4=CC(=NC5=C4C=C(C=C5)OC)C6=CC=CC=C6)Cl

InChI

InChI=1S/C31H28ClN3O3/c1-18-8-10-26-28(29(18)32)23-16-31(17-36,13-12-25(23)33-26)35-30(37)22-15-27(19-6-4-3-5-7-19)34-24-11-9-20(38-2)14-21(22)24/h3-11,14-15,33,36H,12-13,16-17H2,1-2H3,(H,35,37)