(1-azanyl-7-oxidanylidene-azepan-3-yl) (E)-3-phenylprop-2-enoate

Systemtic Name: (1-azanyl-7-oxidanylidene-azepan-3-yl) (E)-3-phenylprop-2-enoate Openeye Name: (1-amino-7-oxo-azepan-3-yl) (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid (1-amino-7-oxo-3-azepanyl) ester IUPAC Name: (1-amino-7-oxoazepan-3-yl) (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid (1-amino-7-keto-azepan-3-yl) ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C(=O)C1)N)OC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

C1CC(CN(C(=O)C1)N)OC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O3/c16-17-11-13(7-4-8-14(17)18)20-15(19)10-9-12-5-2-1-3-6-12/h1-3,5-6,9-10,13H,4,7-8,11,16H2/b10-9+