methyl N-[1-[(E)-azanyl(azepin-3-ylidene)methoxy]propan-2-yl]carbamate

Systemtic Name: methyl N-[1-[(E)-azanyl(azepin-3-ylidene)methoxy]propan-2-yl]carbamate Openeye Name: methyl N-[2-[(E)-amino(azepin-3-ylidene)methoxy]-1-methyl-ethyl]carbamate CAS Name: N-[1-[(E)-amino(3-azepinylidene)methoxy]propan-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[1-[(E)-amino(azepin-3-ylidene)methoxy]propan-2-yl]carbamate Traditional Name: N-[2-[(E)-amino(azepin-3-ylidene)methoxy]-1-methyl-ethyl]carbamic acid methyl ester Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=C1C=CC=CN=C1)N)NC(=O)OC

Isomeric SMILES

CC(CO/C(=C/1\C=CC=CN=C1)/N)NC(=O)OC

InChI

InChI=1S/C12H17N3O3/c1-9(15-12(16)17-2)8-18-11(13)10-5-3-4-6-14-7-10/h3-7,9H,8,13H2,1-2H3,(H,15,16)/b11-10+