N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(8-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(8-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(8-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]butyramide Formula: C26H33N4O3+ MolecularWeight: 449.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NCC(C3=CC=CC=C3OC)[NH+]4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)NC[C@@H](C3=CC=CC=C3OC)[NH+]4CCCC4

InChI

InChI=1S/C26H32N4O3/c1-19-9-7-11-21-25(19)28-18-30(26(21)32)16-8-13-24(31)27-17-22(29-14-5-6-15-29)20-10-3-4-12-23(20)33-2/h3-4,7,9-12,18,22H,5-6,8,13-17H2,1-2H3,(H,27,31)/p+1/t22-/m0/s1