ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[bis(2-chloroethyl)amino-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[bis(2-chloroethyl)carbamoylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[bis(2-chloroethyl)carbamoylamino]-3-phenyl-propionic acid ethyl ester Formula: C16H22Cl2N2O3 MolecularWeight: 361.26348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)N(CCCl)CCCl

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)N(CCCl)CCCl

InChI

InChI=1S/C16H22Cl2N2O3/c1-2-23-15(21)14(12-13-6-4-3-5-7-13)19-16(22)20(10-8-17)11-9-18/h3-7,14H,2,8-12H2,1H3,(H,19,22)/t14-/m0/s1