tert-butyl 1-[(4-methoxyphenyl)-[2-(3-methoxyphenyl)pyridin-4-yl]amino]-4-methyl-piperidin-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-[(4-methoxyphenyl)-[2-(3-methoxyphenyl)pyridin-4-yl]amino]-4-methyl-piperidin-1-ium-1-carboxylate Openeye Name: tert-butyl 1-(4-methoxy-N-[2-(3-methoxyphenyl)-4-pyridyl]anilino)-4-methyl-piperidin-1-ium-1-carboxylate CAS Name: 1-(4-methoxy-N-[2-(3-methoxyphenyl)-4-pyridinyl]anilino)-4-methyl-1-piperidin-1-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(4-methoxy-N-[2-(3-methoxyphenyl)pyridin-4-yl]anilino)-4-methylpiperidin-1-ium-1-carboxylate Traditional Name: 1-(4-methoxy-N-[2-(3-methoxyphenyl)-4-pyridyl]anilino)-4-methyl-piperidin-1-ium-1-carboxylic acid tert-butyl ester Formula: C30H38N3O4+ MolecularWeight: 504.64042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](CC1)(C(=O)OC(C)(C)C)N(C2=CC=C(C=C2)OC)C3=CC(=NC=C3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1CC[N+](CC1)(C(=O)OC(C)(C)C)N(C2=CC=C(C=C2)OC)C3=CC(=NC=C3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C30H38N3O4/c1-22-15-18-33(19-16-22,29(34)37-30(2,3)4)32(24-10-12-26(35-5)13-11-24)25-14-17-31-28(21-25)23-8-7-9-27(20-23)36-6/h7-14,17,20-22H,15-16,18-19H2,1-6H3/q+1