(2S)-2-(acridin-10-ium-9-ylamino)-5-[[azanyl(nitramido)methylidene]amino]pentanoate

Systemtic Name: (2S)-2-(acridin-10-ium-9-ylamino)-5-[[azanyl(nitramido)methylidene]amino]pentanoate Openeye Name: (2S)-2-(acridin-10-ium-9-ylamino)-5-[[amino(nitramido)methylene]amino]pentanoate CAS Name: (2S)-2-(9-acridin-10-iumylamino)-5-[[amino(nitramido)methylidene]amino]pentanoate IUPAC Name: (2S)-2-(acridin-10-ium-9-ylamino)-5-[[amino(nitramido)methylidene]amino]pentanoate Traditional Name: (2S)-2-(acridin-10-ium-9-ylamino)-5-[[amino(nitramido)methylene]amino]valerate Formula: C19H20N6O4 MolecularWeight: 396.3999

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)NC(CCCN=C(N)N[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)N[C@@H](CCCN=C(N)N[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C19H20N6O4/c20-19(24-25(28)29)21-11-5-10-16(18(26)27)23-17-12-6-1-3-8-14(12)22-15-9-4-2-7-13(15)17/h1-4,6-9,16H,5,10-11H2,(H,22,23)(H,26,27)(H3,20,21,24)/t16-/m0/s1