4-azanyl-5-chloranyl-2-methoxy-N-piperidin-1-yl-benzamide; (E)-but-2-enedioate

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-piperidin-1-yl-benzamide; (E)-but-2-enedioate Openeye Name: 4-amino-5-chloro-2-methoxy-N-(1-piperidyl)benzamide; (E)-but-2-enedioate CAS Name: 4-amino-5-chloro-2-methoxy-N-(1-piperidinyl)benzamide; (E)-2-butenedioate IUPAC Name: 4-amino-5-chloro-2-methoxy-N-piperidin-1-ylbenzamide; (E)-but-2-enedioate Traditional Name: 4-amino-5-chloro-2-methoxy-N-piperidino-benzamide fumarate Formula: C17H20ClN3O6-2 MolecularWeight: 397.8102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NN2CCCCC2)Cl)N.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NN2CCCCC2)Cl)N.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C13H18ClN3O2.C4H4O4/c1-19-12-8-11(15)10(14)7-9(12)13(18)16-17-5-3-2-4-6-17;5-3(6)1-2-4(7)8/h7-8H,2-6,15H2,1H3,(H,16,18);1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+