1-butyl-2-methyl-5-oxidanyl-N-[1-(2-phenoxyethyl)piperidin-4-yl]indole-3-carboxamide

Systemtic Name: 1-butyl-2-methyl-5-oxidanyl-N-[1-(2-phenoxyethyl)piperidin-4-yl]indole-3-carboxamide Openeye Name: 1-butyl-5-hydroxy-2-methyl-N-[1-(2-phenoxyethyl)-4-piperidyl]indole-3-carboxamide CAS Name: 1-butyl-5-hydroxy-2-methyl-N-[1-(2-phenoxyethyl)-4-piperidinyl]-3-indolecarboxamide IUPAC Name: 1-butyl-5-hydroxy-2-methyl-N-[1-(2-phenoxyethyl)piperidin-4-yl]indole-3-carboxamide Traditional Name: 1-butyl-5-hydroxy-2-methyl-N-[1-(2-phenoxyethyl)-4-piperidyl]indole-3-carboxamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C=CC(=C2)O)C(=O)NC3CCN(CC3)CCOC4=CC=CC=C4)C

Isomeric SMILES

CCCCN1C(=C(C2=C1C=CC(=C2)O)C(=O)NC3CCN(CC3)CCOC4=CC=CC=C4)C

InChI

InChI=1S/C27H35N3O3/c1-3-4-14-30-20(2)26(24-19-22(31)10-11-25(24)30)27(32)28-21-12-15-29(16-13-21)17-18-33-23-8-6-5-7-9-23/h5-11,19,21,31H,3-4,12-18H2,1-2H3,(H,28,32)