N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-3-(4-methoxyphenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-3-(4-methoxyphenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-3-(4-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-[(1-ethyl-2-pyrrolidin-1-iumyl)methyl]-3-(4-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-3-(4-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-1-keto-3-(4-methoxyphenyl)-2-methyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC=C(C=C4)OC

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H31N3O3/c1-4-28-15-7-8-18(28)16-26-24(29)22-20-9-5-6-10-21(20)25(30)27(2)23(22)17-11-13-19(31-3)14-12-17/h5-6,9-14,18,22-23H,4,7-8,15-16H2,1-3H3,(H,26,29)/p+1