6-methoxy-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-1H-indole-2-carboxamide

Systemtic Name: 6-methoxy-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-1H-indole-2-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-methoxy-1H-indole-2-carboxamide CAS Name: 6-methoxy-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-1H-indole-2-carboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-methoxy-1H-indole-2-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-6-methoxy-1H-indole-2-carboxamide Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(N2)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(N2)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O2/c1-26-18-8-7-16-11-20(23-19(16)12-18)21(25)22-17-9-10-24(14-17)13-15-5-3-2-4-6-15/h2-8,11-12,17,23H,9-10,13-14H2,1H3,(H,22,25)/p+1/t17-/m0/s1