(Z)-but-2-enedioate; 3-(8-chloranyl-2,3-dihydro-1-benzoxepin-5-yl)-N,N-dimethyl-propan-1-amine

Systemtic Name: (Z)-but-2-enedioate; 3-(8-chloranyl-2,3-dihydro-1-benzoxepin-5-yl)-N,N-dimethyl-propan-1-amine Openeye Name: (Z)-but-2-enedioate; 3-(8-chloro-2,3-dihydro-1-benzoxepin-5-yl)-N,N-dimethyl-propan-1-amine CAS Name: (Z)-2-butenedioate; 3-(8-chloro-2,3-dihydro-1-benzoxepin-5-yl)-N,N-dimethyl-1-propanamine IUPAC Name: (Z)-but-2-enedioate; 3-(8-chloro-2,3-dihydro-1-benzoxepin-5-yl)-N,N-dimethylpropan-1-amine Traditional Name: 3-(8-chloro-2,3-dihydro-1-benzoxepin-5-yl)propyl-dimethyl-amine maleate Formula: C19H22ClNO5-2 MolecularWeight: 379.83468

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1=CCCOC2=C1C=CC(=C2)Cl.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CN(C)CCCC1=CCCOC2=C1C=CC(=C2)Cl.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C15H20ClNO.C4H4O4/c1-17(2)9-3-5-12-6-4-10-18-15-11-13(16)7-8-14(12)15;5-3(6)1-2-4(7)8/h6-8,11H,3-5,9-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-