methyl 4-[(6-azanyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[(6-azanyl-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[(6-amino-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]-3-methoxy-benzoate CAS Name: 4-[(6-amino-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[(6-amino-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]-3-methoxybenzoate Traditional Name: 4-[(6-amino-2,3-dihydro-1,4-benzoxazin-4-yl)methyl]-3-methoxy-benzoic acid methyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CN2CCOC3=C2C=C(C=C3)N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CN2CCOC3=C2C=C(C=C3)N

InChI

InChI=1S/C18H20N2O4/c1-22-17-9-12(18(21)23-2)3-4-13(17)11-20-7-8-24-16-6-5-14(19)10-15(16)20/h3-6,9-10H,7-8,11,19H2,1-2H3