1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea Openeye Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea CAS Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-[2-(1-pyrrolidin-1-iumyl)ethyl]urea IUPAC Name: 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea Traditional Name: 1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea Formula: C26H33N4O5+ MolecularWeight: 481.56402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N(CC[NH+]2CCCC2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N(CC[NH+]2CCCC2)CC3=CC4=CC(=C(C=C4NC3=O)OC)OC

InChI

InChI=1S/C26H32N4O5/c1-33-21-8-6-20(7-9-21)27-26(32)30(13-12-29-10-4-5-11-29)17-19-14-18-15-23(34-2)24(35-3)16-22(18)28-25(19)31/h6-9,14-16H,4-5,10-13,17H2,1-3H3,(H,27,32)(H,28,31)/p+1