methyl 3-[5-azanyl-4-(butoxycarbonylamino)-5-oxidanylidene-pentan-2-yl]benzoate

Systemtic Name: methyl 3-[5-azanyl-4-(butoxycarbonylamino)-5-oxidanylidene-pentan-2-yl]benzoate Openeye Name: methyl 3-[4-amino-3-(butoxycarbonylamino)-1-methyl-4-oxo-butyl]benzoate CAS Name: 3-[5-amino-4-[[butoxy(oxo)methyl]amino]-5-oxopentan-2-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[5-amino-4-(butoxycarbonylamino)-5-oxopentan-2-yl]benzoate Traditional Name: 3-[4-amino-3-(butoxycarbonylamino)-4-keto-1-methyl-butyl]benzoic acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC(CC(C)C1=CC=CC(=C1)C(=O)OC)C(=O)N

Isomeric SMILES

CCCCOC(=O)NC(CC(C)C1=CC=CC(=C1)C(=O)OC)C(=O)N

InChI

InChI=1S/C18H26N2O5/c1-4-5-9-25-18(23)20-15(16(19)21)10-12(2)13-7-6-8-14(11-13)17(22)24-3/h6-8,11-12,15H,4-5,9-10H2,1-3H3,(H2,19,21)(H,20,23)