4-azanyl-N-pyrrol-1-yl-butanamide; (E)-but-2-enedioic acid

Systemtic Name: 4-azanyl-N-pyrrol-1-yl-butanamide; (E)-but-2-enedioic acid Openeye Name: 4-amino-N-pyrrol-1-yl-butanamide; fumaric acid CAS Name: 4-amino-N-(1-pyrrolyl)butanamide; (E)-2-butenedioic acid IUPAC Name: 4-amino-N-pyrrol-1-ylbutanamide; (E)-but-2-enedioic acid Traditional Name: 4-amino-N-pyrrol-1-yl-butyramide; fumaric acid Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)NC(=O)CCCN.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CN(C=C1)NC(=O)CCCN.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H13N3O.C4H4O4/c9-5-3-4-8(12)10-11-6-1-2-7-11;5-3(6)1-2-4(7)8/h1-2,6-7H,3-5,9H2,(H,10,12);1-2H,(H,5,6)(H,7,8)/b;2-1+