4-azanyl-5-chloranyl-2-methoxy-N-[1-methyl-2-(phenylmethyl)pyrazolidin-4-yl]benzamide; (E)-but-2-enedioic acid

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[1-methyl-2-(phenylmethyl)pyrazolidin-4-yl]benzamide; (E)-but-2-enedioic acid Openeye Name: 4-amino-N-(1-benzyl-2-methyl-pyrazolidin-4-yl)-5-chloro-2-methoxy-benzamide; fumaric acid CAS Name: 4-amino-5-chloro-2-methoxy-N-[1-methyl-2-(phenylmethyl)-4-pyrazolidinyl]benzamide; (E)-2-butenedioic acid IUPAC Name: 4-amino-N-(1-benzyl-2-methylpyrazolidin-4-yl)-5-chloro-2-methoxybenzamide; (E)-but-2-enedioic acid Traditional Name: 4-amino-N-(1-benzyl-2-methyl-pyrazolidin-4-yl)-5-chloro-2-methoxy-benzamide; fumaric acid Formula: C23H27ClN4O6 MolecularWeight: 490.93668

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CN1CC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3OC)N)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CC(CN1CC2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3OC)N)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H23ClN4O2.C4H4O4/c1-23-11-14(12-24(23)10-13-6-4-3-5-7-13)22-19(25)15-8-16(20)17(21)9-18(15)26-2;5-3(6)1-2-4(7)8/h3-9,14H,10-12,21H2,1-2H3,(H,22,25);1-2H,(H,5,6)(H,7,8)/b;2-1+