methyl 3-[(5-bromanylnaphthalen-2-yl)carbonylamino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-[(5-bromanylnaphthalen-2-yl)carbonylamino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 2-(benzyloxycarbonylamino)-3-[(5-bromonaphthalene-2-carbonyl)amino]propanoate CAS Name: 3-[[(5-bromo-2-naphthalenyl)-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-[(5-bromonaphthalene-2-carbonyl)amino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[(5-bromo-2-naphthoyl)amino]propionic acid methyl ester Formula: C23H21BrN2O5 MolecularWeight: 485.32724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CNC(=O)C1=CC2=C(C=C1)C(=CC=C2)Br)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CNC(=O)C1=CC2=C(C=C1)C(=CC=C2)Br)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21BrN2O5/c1-30-22(28)20(26-23(29)31-14-15-6-3-2-4-7-15)13-25-21(27)17-10-11-18-16(12-17)8-5-9-19(18)24/h2-12,20H,13-14H2,1H3,(H,25,27)(H,26,29)