methyl 2-[[3-[(1-oxidanidylpyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinolin-4-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[[3-[(1-oxidanidylpyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinolin-4-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl 2-[[3-[(1-oxidopyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinoline-4-carbonyl]amino]-2-phenyl-acetate CAS Name: 2-[[[3-[(1-oxido-1-pyrrolidin-1-iumyl)methyl]-2-phenyl-4-quinolinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[[3-[(1-oxidopyrrolidin-1-ium-1-yl)methyl]-2-phenylquinoline-4-carbonyl]amino]-2-phenylacetate Traditional Name: 2-[[3-[(1-oxidopyrrolidin-1-ium-1-yl)methyl]-2-phenyl-quinoline-4-carbonyl]amino]-2-phenyl-acetic acid methyl ester Formula: C30H29N3O4 MolecularWeight: 495.56896

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C[N+]5(CCCC5)[O-]

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)C[N+]5(CCCC5)[O-]

InChI

InChI=1S/C30H29N3O4/c1-37-30(35)28(22-14-6-3-7-15-22)32-29(34)26-23-16-8-9-17-25(23)31-27(21-12-4-2-5-13-21)24(26)20-33(36)18-10-11-19-33/h2-9,12-17,28H,10-11,18-20H2,1H3,(H,32,34)