4-[[4-[4-(dimethylamino)butanoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[[4-[4-(dimethylamino)butanoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-[[4-[4-(dimethylamino)butanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[[[4-[[4-(dimethylamino)-1-oxobutyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[[4-[4-(dimethylamino)butanoylamino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[[4-[4-(dimethylamino)butanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxylic acid Formula: C18H25N5O4 MolecularWeight: 375.4222

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)O)C)NC(=O)CCCN(C)C

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)O)C)NC(=O)CCCN(C)C

InChI

InChI=1S/C18H25N5O4/c1-21(2)7-5-6-16(24)19-12-8-14(22(3)10-12)17(25)20-13-9-15(18(26)27)23(4)11-13/h8-11H,5-7H2,1-4H3,(H,19,24)(H,20,25)(H,26,27)