(phenylmethyl) N-[1-oxidanylidene-3-(5-oxidanyl-1H-indol-3-yl)-1-(prop-2-enylamino)propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-oxidanylidene-3-(5-oxidanyl-1H-indol-3-yl)-1-(prop-2-enylamino)propan-2-yl]carbamate Openeye Name: benzyl N-[2-(allylamino)-1-[(5-hydroxy-1H-indol-3-yl)methyl]-2-oxo-ethyl]carbamate CAS Name: N-[3-(5-hydroxy-1H-indol-3-yl)-1-oxo-1-(prop-2-enylamino)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-(5-hydroxy-1H-indol-3-yl)-1-oxo-1-(prop-2-enylamino)propan-2-yl]carbamate Traditional Name: N-[2-(allylamino)-1-[(5-hydroxy-1H-indol-3-yl)methyl]-2-keto-ethyl]carbamic acid benzyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(CC1=CNC2=C1C=C(C=C2)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)C(CC1=CNC2=C1C=C(C=C2)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O4/c1-2-10-23-21(27)20(25-22(28)29-14-15-6-4-3-5-7-15)11-16-13-24-19-9-8-17(26)12-18(16)19/h2-9,12-13,20,24,26H,1,10-11,14H2,(H,23,27)(H,25,28)