3-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(phenylmethyl)carbamoyl]amino]propyl-diethyl-azanium

Systemtic Name: 3-[(5,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-[(phenylmethyl)carbamoyl]amino]propyl-diethyl-azanium Openeye Name: 3-[benzylcarbamoyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-diethyl-ammonium CAS Name: 3-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[oxo-[(phenylmethyl)amino]methyl]amino]propyl-diethylammonium IUPAC Name: 3-[benzylcarbamoyl-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]amino]propyl-diethylazanium Traditional Name: 3-[benzylcarbamoyl-[(2-keto-5,8-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl-diethyl-ammonium Formula: C27H37N4O2+ MolecularWeight: 449.60828

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(CC1=CC2=C(C=CC(=C2NC1=O)C)C)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCN(CC1=CC2=C(C=CC(=C2NC1=O)C)C)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C27H36N4O2/c1-5-30(6-2)15-10-16-31(27(33)28-18-22-11-8-7-9-12-22)19-23-17-24-20(3)13-14-21(4)25(24)29-26(23)32/h7-9,11-14,17H,5-6,10,15-16,18-19H2,1-4H3,(H,28,33)(H,29,32)/p+1