[(3S,4R)-3-ethenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]-(1-methylindol-6-yl)methanone

Systemtic Name: [(3S,4R)-3-ethenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]-(1-methylindol-6-yl)methanone Openeye Name: (1-methylindol-6-yl)-[(3R,4S)-3-[(4-phenyl-1-piperidyl)methyl]-4-vinyl-pyrrolidin-1-yl]methanone CAS Name: [(3S,4R)-3-ethenyl-4-[(4-phenyl-1-piperidinyl)methyl]-1-pyrrolidinyl]-(1-methyl-6-indolyl)methanone IUPAC Name: [(3S,4R)-3-ethenyl-4-[(4-phenylpiperidin-1-yl)methyl]pyrrolidin-1-yl]-(1-methylindol-6-yl)methanone Traditional Name: (1-methylindol-6-yl)-[(3R,4S)-3-[(4-phenylpiperidino)methyl]-4-vinyl-pyrrolidino]methanone Formula: C28H33N3O MolecularWeight: 427.58112

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=C(C=C2)C(=O)N3CC(C(C3)C=C)CN4CCC(CC4)C5=CC=CC=C5

Isomeric SMILES

CN1C=CC2=C1C=C(C=C2)C(=O)N3C[C@H]([C@@H](C3)C=C)CN4CCC(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H33N3O/c1-3-21-19-31(28(32)25-10-9-24-11-14-29(2)27(24)17-25)20-26(21)18-30-15-12-23(13-16-30)22-7-5-4-6-8-22/h3-11,14,17,21,23,26H,1,12-13,15-16,18-20H2,2H3/t21-,26-/m1/s1