(2S)-2-azanyl-N-[2-chloroethyl(nitroso)carbamoyl]-N-cyclohexyl-3-phenyl-propanamide

Systemtic Name: (2S)-2-azanyl-N-[2-chloroethyl(nitroso)carbamoyl]-N-cyclohexyl-3-phenyl-propanamide Openeye Name: (2S)-2-amino-N-[2-chloroethyl(nitroso)carbamoyl]-N-cyclohexyl-3-phenyl-propanamide CAS Name: (2S)-2-amino-N-[[2-chloroethyl(nitroso)amino]-oxomethyl]-N-cyclohexyl-3-phenylpropanamide IUPAC Name: (2S)-2-amino-N-[2-chloroethyl(nitroso)carbamoyl]-N-cyclohexyl-3-phenylpropanamide Traditional Name: (2S)-2-amino-N-[2-chloroethyl(nitroso)carbamoyl]-N-cyclohexyl-3-phenyl-propionamide Formula: C18H25ClN4O3 MolecularWeight: 380.8691

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C(=O)C(CC2=CC=CC=C2)N)C(=O)N(CCCl)N=O

Isomeric SMILES

C1CCC(CC1)N(C(=O)[C@H](CC2=CC=CC=C2)N)C(=O)N(CCCl)N=O

InChI

InChI=1S/C18H25ClN4O3/c19-11-12-22(21-26)18(25)23(15-9-5-2-6-10-15)17(24)16(20)13-14-7-3-1-4-8-14/h1,3-4,7-8,15-16H,2,5-6,9-13,20H2/t16-/m0/s1