ethyl 3-[2-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: ethyl 3-[2-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]ethanoylamino]-4-methyl-pentanoate Openeye Name: ethyl 3-[[2-[[3-(hydrazinomethyleneamino)benzoyl]amino]acetyl]amino]-4-methyl-pentanoate CAS Name: 3-[[2-[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]-1-oxoethyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[[3-(hydrazinylmethylideneamino)benzoyl]amino]acetyl]amino]-4-methylpentanoate Traditional Name: 3-[[2-[[3-(hydrazinomethyleneamino)benzoyl]amino]acetyl]amino]-4-methyl-valeric acid ethyl ester Formula: C18H27N5O4 MolecularWeight: 377.43808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)C)NC(=O)CNC(=O)C1=CC(=CC=C1)N=CNN

Isomeric SMILES

CCOC(=O)CC(C(C)C)NC(=O)CNC(=O)C1=CC(=CC=C1)N=CNN

InChI

InChI=1S/C18H27N5O4/c1-4-27-17(25)9-15(12(2)3)23-16(24)10-20-18(26)13-6-5-7-14(8-13)21-11-22-19/h5-8,11-12,15H,4,9-10,19H2,1-3H3,(H,20,26)(H,21,22)(H,23,24)