ethanedioic acid; N-[(1-phenylpyrrol-2-yl)methyl]cyclohexanamine

Systemtic Name: ethanedioic acid; N-[(1-phenylpyrrol-2-yl)methyl]cyclohexanamine Openeye Name: oxalic acid; N-[(1-phenylpyrrol-2-yl)methyl]cyclohexanamine CAS Name: oxalic acid; N-[(1-phenyl-2-pyrrolyl)methyl]cyclohexanamine IUPAC Name: oxalic acid; N-[(1-phenylpyrrol-2-yl)methyl]cyclohexanamine Traditional Name: cyclohexyl-[(1-phenylpyrrol-2-yl)methyl]amine; oxalic acid Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCC2=CC=CN2C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)NCC2=CC=CN2C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22N2.C2H2O4/c1-3-8-15(9-4-1)18-14-17-12-7-13-19(17)16-10-5-2-6-11-16;3-1(4)2(5)6/h2,5-7,10-13,15,18H,1,3-4,8-9,14H2;(H,3,4)(H,5,6)