[2-chloroethyl-[4-[(4-nitrophenyl)carbonylamino]butylcarbamoyl]amino]-oxidanylidene-azanium

Systemtic Name: [2-chloroethyl-[4-[(4-nitrophenyl)carbonylamino]butylcarbamoyl]amino]-oxidanylidene-azanium Openeye Name: [2-chloroethyl-[4-[(4-nitrobenzoyl)amino]butylcarbamoyl]amino]-oxo-ammonium CAS Name: [2-chloroethyl-[[4-[[(4-nitrophenyl)-oxomethyl]amino]butylamino]-oxomethyl]amino]-oxoammonium IUPAC Name: [2-chloroethyl-[4-[(4-nitrobenzoyl)amino]butylcarbamoyl]amino]-oxoazanium Traditional Name: [2-chloroethyl-[4-[(4-nitrobenzoyl)amino]butylcarbamoyl]amino]-keto-ammonium Formula: C14H19ClN5O5+ MolecularWeight: 372.78416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCCCNC(=O)N(CCCl)[NH+]=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCCCNC(=O)N(CCCl)[NH+]=O)[N+](=O)[O-]

InChI

InChI=1S/C14H18ClN5O5/c15-7-10-19(18-23)14(22)17-9-2-1-8-16-13(21)11-3-5-12(6-4-11)20(24)25/h3-6H,1-2,7-10H2,(H,16,21)(H,17,22)/p+1