4-chloranyl-3-[5-methyl-3-(2-pyrrolidin-1-ylethylamino)-1,2,4-benzotriazin-7-yl]phenol

Systemtic Name: 4-chloranyl-3-[5-methyl-3-(2-pyrrolidin-1-ylethylamino)-1,2,4-benzotriazin-7-yl]phenol Openeye Name: 4-chloro-3-[5-methyl-3-(2-pyrrolidin-1-ylethylamino)-1,2,4-benzotriazin-7-yl]phenol CAS Name: 4-chloro-3-[5-methyl-3-[2-(1-pyrrolidinyl)ethylamino]-1,2,4-benzotriazin-7-yl]phenol IUPAC Name: 4-chloro-3-[5-methyl-3-(2-pyrrolidin-1-ylethylamino)-1,2,4-benzotriazin-7-yl]phenol Traditional Name: 4-chloro-3-[5-methyl-3-(2-pyrrolidinoethylamino)-1,2,4-benzotriazin-7-yl]phenol Formula: C20H22ClN5O MolecularWeight: 383.87458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C3=C(C=CC(=C3)O)Cl)N=NC(=N2)NCCN4CCCC4

Isomeric SMILES

CC1=C2C(=CC(=C1)C3=C(C=CC(=C3)O)Cl)N=NC(=N2)NCCN4CCCC4

InChI

InChI=1S/C20H22ClN5O/c1-13-10-14(16-12-15(27)4-5-17(16)21)11-18-19(13)23-20(25-24-18)22-6-9-26-7-2-3-8-26/h4-5,10-12,27H,2-3,6-9H2,1H3,(H,22,23,25)