2-(6-methoxynaphthalen-2-yl)-2-[[1-(methylazaniumyl)piperidin-3-yl]methyl]pentanoate

Systemtic Name: 2-(6-methoxynaphthalen-2-yl)-2-[[1-(methylazaniumyl)piperidin-3-yl]methyl]pentanoate Openeye Name: 2-(6-methoxy-2-naphthyl)-2-[[1-(methylammonio)-3-piperidyl]methyl]pentanoate CAS Name: 2-(6-methoxy-2-naphthalenyl)-2-[[1-(methylammonio)-3-piperidinyl]methyl]pentanoate IUPAC Name: 2-(6-methoxynaphthalen-2-yl)-2-[[1-(methylazaniumyl)piperidin-3-yl]methyl]pentanoate Traditional Name: 2-(6-methoxy-2-naphthyl)-2-[[1-(methylammonio)-3-piperidyl]methyl]valerate Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1CCCN(C1)[NH2+]C)(C2=CC3=C(C=C2)C=C(C=C3)OC)C(=O)[O-]

Isomeric SMILES

CCCC(CC1CCCN(C1)[NH2+]C)(C2=CC3=C(C=C2)C=C(C=C3)OC)C(=O)[O-]

InChI

InChI=1S/C23H32N2O3/c1-4-11-23(22(26)27,15-17-6-5-12-25(16-17)24-2)20-9-7-19-14-21(28-3)10-8-18(19)13-20/h7-10,13-14,17,24H,4-6,11-12,15-16H2,1-3H3,(H,26,27)