methyl 3-[bis(2-chloroethyl)amino]-4-methoxy-benzoate

Systemtic Name: methyl 3-[bis(2-chloroethyl)amino]-4-methoxy-benzoate Openeye Name: methyl 3-[bis(2-chloroethyl)amino]-4-methoxy-benzoate CAS Name: 3-[bis(2-chloroethyl)amino]-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-[bis(2-chloroethyl)amino]-4-methoxybenzoate Traditional Name: 3-[bis(2-chloroethyl)amino]-4-methoxy-benzoic acid methyl ester Formula: C13H17Cl2NO3 MolecularWeight: 306.18498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC)N(CCCl)CCCl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC)N(CCCl)CCCl

InChI

InChI=1S/C13H17Cl2NO3/c1-18-12-4-3-10(13(17)19-2)9-11(12)16(7-5-14)8-6-15/h3-4,9H,5-8H2,1-2H3