(2S)-2-acetamido-6-[[nitroso(prop-2-enyl)carbamoyl]amino]-N-(phenylmethyl)hexanamide

Systemtic Name: (2S)-2-acetamido-6-[[nitroso(prop-2-enyl)carbamoyl]amino]-N-(phenylmethyl)hexanamide Openeye Name: (2S)-2-acetamido-6-[[allyl(nitroso)carbamoyl]amino]-N-benzyl-hexanamide CAS Name: (2S)-2-acetamido-6-[[[nitroso(prop-2-enyl)amino]-oxomethyl]amino]-N-(phenylmethyl)hexanamide IUPAC Name: (2S)-2-acetamido-N-benzyl-6-[[nitroso(prop-2-enyl)carbamoyl]amino]hexanamide Traditional Name: (2S)-2-acetamido-6-[[allyl(nitroso)carbamoyl]amino]-N-benzyl-hexanamide Formula: C19H27N5O4 MolecularWeight: 389.44878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCNC(=O)N(CC=C)N=O)C(=O)NCC1=CC=CC=C1

Isomeric SMILES

CC(=O)N[C@@H](CCCCNC(=O)N(CC=C)N=O)C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C19H27N5O4/c1-3-13-24(23-28)19(27)20-12-8-7-11-17(22-15(2)25)18(26)21-14-16-9-5-4-6-10-16/h3-6,9-10,17H,1,7-8,11-14H2,2H3,(H,20,27)(H,21,26)(H,22,25)/t17-/m0/s1