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

Systemtic Name: methyl 4-[bis(2-chloroethyl)amino]-3-(cyclopropylmethoxy)benzoate Openeye Name: methyl 4-[bis(2-chloroethyl)amino]-3-(cyclopropylmethoxy)benzoate CAS Name: 4-[bis(2-chloroethyl)amino]-3-(cyclopropylmethoxy)benzoic acid methyl ester IUPAC Name: methyl 4-[bis(2-chloroethyl)amino]-3-(cyclopropylmethoxy)benzoate Traditional Name: 4-[bis(2-chloroethyl)amino]-3-(cyclopropylmethoxy)benzoic acid methyl ester Formula: C16H21Cl2NO3 MolecularWeight: 346.24884

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N(CCCl)CCCl)OCC2CC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N(CCCl)CCCl)OCC2CC2

InChI

InChI=1S/C16H21Cl2NO3/c1-21-16(20)13-4-5-14(19(8-6-17)9-7-18)15(10-13)22-11-12-2-3-12/h4-5,10,12H,2-3,6-9,11H2,1H3