N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide

Systemtic Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide Openeye Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide CAS Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-3-quinolin-1-iumyl]methyl]-3-(3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methylquinolin-1-ium-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propanamide Traditional Name: N-cyclopropyl-N-[[2-(dimethylamino)-7-methyl-quinolin-1-ium-3-yl]methyl]-3-(3-methylpyrazol-1-yl)propionamide Formula: C23H30N5O+ MolecularWeight: 392.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C3CC3)C(=O)CCN4C=CC(=N4)C)N(C)C

Isomeric SMILES

CC1=CC2=[NH+]C(=C(C=C2C=C1)CN(C3CC3)C(=O)CCN4C=CC(=N4)C)N(C)C

InChI

InChI=1S/C23H29N5O/c1-16-5-6-18-14-19(23(26(3)4)24-21(18)13-16)15-28(20-7-8-20)22(29)10-12-27-11-9-17(2)25-27/h5-6,9,11,13-14,20H,7-8,10,12,15H2,1-4H3/p+1