methyl 4-[(5-azanyl-1-methoxy-1-oxidanylidene-pentan-2-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(5-azanyl-1-methoxy-1-oxidanylidene-pentan-2-yl)carbamoyl]benzoate Openeye Name: methyl 4-[(4-amino-1-methoxycarbonyl-butyl)carbamoyl]benzoate CAS Name: 4-[[(5-amino-1-methoxy-1-oxopentan-2-yl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-amino-1-methoxy-1-oxopentan-2-yl)carbamoyl]benzoate Traditional Name: 4-[(4-amino-1-carbomethoxy-butyl)carbamoyl]benzoic acid methyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC(CCCN)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC(CCCN)C(=O)OC

InChI

InChI=1S/C15H20N2O5/c1-21-14(19)11-7-5-10(6-8-11)13(18)17-12(4-3-9-16)15(20)22-2/h5-8,12H,3-4,9,16H2,1-2H3,(H,17,18)