N,1-dimethyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]indole-2-carboxamide

Systemtic Name: N,1-dimethyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]indole-2-carboxamide Openeye Name: N,1-dimethyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]indole-2-carboxamide CAS Name: N,1-dimethyl-N-[(3S)-1-(3-phenylpropyl)-3-piperidin-1-iumyl]-2-indolecarboxamide IUPAC Name: N,1-dimethyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]indole-2-carboxamide Traditional Name: N,1-dimethyl-N-[(3S)-1-(3-phenylpropyl)piperidin-1-ium-3-yl]indole-2-carboxamide Formula: C25H32N3O+ MolecularWeight: 390.54108

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)N(C)C3CCC[NH+](C3)CCCC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)N(C)[C@H]3CCC[NH+](C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O/c1-26(25(29)24-18-21-13-6-7-15-23(21)27(24)2)22-14-9-17-28(19-22)16-8-12-20-10-4-3-5-11-20/h3-7,10-11,13,15,18,22H,8-9,12,14,16-17,19H2,1-2H3/p+1/t22-/m0/s1