5-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-2-carboxamide Openeye Name: 5-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-2-carboxamide CAS Name: 5-methyl-N-[(3S)-1-phenethyl-3-piperidin-1-iumyl]-1H-indole-2-carboxamide IUPAC Name: 5-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-2-carboxamide Traditional Name: 5-methyl-N-[(3S)-1-phenethylpiperidin-1-ium-3-yl]-1H-indole-2-carboxamide Formula: C23H28N3O+ MolecularWeight: 362.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2)C(=O)NC3CCC[NH+](C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2)C(=O)N[C@H]3CCC[NH+](C3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O/c1-17-9-10-21-19(14-17)15-22(25-21)23(27)24-20-8-5-12-26(16-20)13-11-18-6-3-2-4-7-18/h2-4,6-7,9-10,14-15,20,25H,5,8,11-13,16H2,1H3,(H,24,27)/p+1/t20-/m0/s1