3-cyanopropyl 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: 3-cyanopropyl 3-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: 3-cyanopropyl 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(3-keto-2-methyl-1,4-benzoxazin-4-yl)propionic acid 3-cyanopropyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OCCCC#N

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)OCCCC#N

InChI

InChI=1S/C16H18N2O4/c1-12-16(20)18(13-6-2-3-7-14(13)22-12)10-8-15(19)21-11-5-4-9-17/h2-3,6-7,12H,4-5,8,10-11H2,1H3