6-[[(1S)-1-cyclopropylethyl]amino]-N-methyl-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[[(1S)-1-cyclopropylethyl]amino]-N-methyl-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: 6-[[(1S)-1-cyclopropylethyl]amino]-N-methyl-N-(2-quinolylmethyl)pyridin-1-ium-3-carboxamide CAS Name: 6-[[(1S)-1-cyclopropylethyl]amino]-N-methyl-N-(2-quinolinylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 6-[[(1S)-1-cyclopropylethyl]amino]-N-methyl-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide Traditional Name: 6-[[(1S)-1-cyclopropylethyl]amino]-N-methyl-N-(2-quinolylmethyl)pyridin-1-ium-3-carboxamide Formula: C22H25N4O+ MolecularWeight: 361.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC2=[NH+]C=C(C=C2)C(=O)N(C)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@@H](C1CC1)NC2=[NH+]C=C(C=C2)C(=O)N(C)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N4O/c1-15(16-7-8-16)24-21-12-10-18(13-23-21)22(27)26(2)14-19-11-9-17-5-3-4-6-20(17)25-19/h3-6,9-13,15-16H,7-8,14H2,1-2H3,(H,23,24)/p+1/t15-/m0/s1