N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]propionamide Formula: C24H29N4O3+ MolecularWeight: 421.51206

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](CNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)[NH+]4CCCC4

InChI

InChI=1S/C24H28N4O3/c1-31-18-8-6-7-17(15-18)21(28-13-4-5-14-28)16-25-23(29)12-11-22-26-20-10-3-2-9-19(20)24(30)27-22/h2-3,6-10,15,21H,4-5,11-14,16H2,1H3,(H,25,29)(H,26,27,30)/p+1/t21-/m0/s1