butanedioate; 1-[(2E)-2-(phenylmethylidene)cyclohexyl]azetidine

Systemtic Name: butanedioate; 1-[(2E)-2-(phenylmethylidene)cyclohexyl]azetidine Openeye Name: 1-[(2E)-2-benzylidenecyclohexyl]azetidine; butanedioate CAS Name: butanedioate; 1-[(2E)-2-(phenylmethylene)cyclohexyl]azetidine IUPAC Name: 1-[(2E)-2-benzylidenecyclohexyl]azetidine; butanedioate Traditional Name: 1-[(2E)-2-benzalcyclohexyl]azetidine; succinate Formula: C20H25NO4-2 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC2=CC=CC=C2)C(C1)N3CCC3.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CC/C(=C\C2=CC=CC=C2)/C(C1)N3CCC3.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H21N.C4H6O4/c1-2-7-14(8-3-1)13-15-9-4-5-10-16(15)17-11-6-12-17;5-3(6)1-2-4(7)8/h1-3,7-8,13,16H,4-6,9-12H2;1-2H2,(H,5,6)(H,7,8)/p-2/b15-13+;