(7-azanyl-1-chloranyl-5,6,7,8-tetrahydro-4H-naphthalen-1-yl)methanol; (E)-but-2-enedioic acid

Systemtic Name: (7-azanyl-1-chloranyl-5,6,7,8-tetrahydro-4H-naphthalen-1-yl)methanol; (E)-but-2-enedioic acid Openeye Name: (7-amino-1-chloro-5,6,7,8-tetrahydro-4H-naphthalen-1-yl)methanol; fumaric acid CAS Name: (7-amino-1-chloro-5,6,7,8-tetrahydro-4H-naphthalen-1-yl)methanol; (E)-2-butenedioic acid IUPAC Name: (7-amino-1-chloro-5,6,7,8-tetrahydro-4H-naphthalen-1-yl)methanol; (E)-but-2-enedioic acid Traditional Name: (7-amino-1-chloro-5,6,7,8-tetrahydro-4H-naphthalen-1-yl)methanol; fumaric acid Formula: C15H20ClNO5 MolecularWeight: 329.776

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1N)C(C=CC2)(CO)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CC2=C(CC1N)C(C=CC2)(CO)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H16ClNO.C4H4O4/c12-11(7-14)5-1-2-8-3-4-9(13)6-10(8)11;5-3(6)1-2-4(7)8/h1,5,9,14H,2-4,6-7,13H2;1-2H,(H,5,6)(H,7,8)/b;2-1+